2-(4-fluoranyl-2-nitro-phenyl)-2-(phenylsulfonyl)ethanenitrile

Systemtic Name: 2-(4-fluoranyl-2-nitro-phenyl)-2-(phenylsulfonyl)ethanenitrile Openeye Name: 2-(benzenesulfonyl)-2-(4-fluoro-2-nitro-phenyl)acetonitrile CAS Name: 2-(benzenesulfonyl)-2-(4-fluoro-2-nitrophenyl)acetonitrile IUPAC Name: 2-(benzenesulfonyl)-2-(4-fluoro-2-nitrophenyl)acetonitrile Traditional Name: 2-besyl-2-(4-fluoro-2-nitro-phenyl)acetonitrile Formula: C14H9FN2O4S MolecularWeight: 320.295663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=C(C=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=C(C=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C14H9FN2O4S/c15-10-6-7-12(13(8-10)17(18)19)14(9-16)22(20,21)11-4-2-1-3-5-11/h1-8,14H